AD72451
1355247-63-0 | 2-Chloro-4-(3-fluoro-4-methylphenyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AD72451
ChemicalName
2-Chloro-4-(3-fluoro-4-methylphenyl)benzonitrile
CasNumber
1355247-63-0
MolecularFormula
C14H9ClFN
MolecularWeight
245.6794
MdlNumber
MFCD21333013
Smiles
N#Cc1ccc(cc1Cl)c1ccc(c(c1)F)C
Complexity
311
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
4.4
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CatalogNumber: AD72451
ChemicalName: 2-Chloro-4-(3-fluoro-4-methylphenyl)benzonitrile
CasNumber: 1355247-63-0
MolecularFormula: C14H9ClFN
MolecularWeight: 245.6794
MdlNumber: MFCD21333013
Smiles: N#Cc1ccc(cc1Cl)c1ccc(c(c1)F)C
Complexity: 311
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 4.4
CatalogNumber:
AD72451
ChemicalName:
2-Chloro-4-(3-fluoro-4-methylphenyl)benzonitrile
CasNumber:
1355247-63-0
MolecularFormula:
C14H9ClFN
MolecularWeight:
245.6794
MdlNumber:
MFCD21333013
Smiles:
N#Cc1ccc(cc1Cl)c1ccc(c(c1)F)C
Complexity:
311
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
4.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1cc(Br)ccc1OC(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOc1cc(Br)ccc1OC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD72453
ChemicalName: N-Butyl 2-bromo-6-fluorobenzylamine
CasNumber: 1355247-58-3
MolecularFormula: C11H15BrFN
MolecularWeight: 260.1459
MdlNumber: MFCD21333059
Smiles: CCCCNCc1c(F)cccc1Br
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 5
Xlogp3: 3.3
CatalogNumber:
AD72453
ChemicalName:
N-Butyl 2-bromo-6-fluorobenzylamine
CasNumber:
1355247-58-3
MolecularFormula:
C11H15BrFN
MolecularWeight:
260.1459
MdlNumber:
MFCD21333059
Smiles:
CCCCNCc1c(F)cccc1Br
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
5
Xlogp3:
3.3
CatalogNumber: AD72454
ChemicalName: 2-Chloro-1-fluoro-4-(3-nitrophenyl)benzene
CasNumber: 1355247-49-2
MolecularFormula: C12H7ClFNO2
MolecularWeight: 251.6409
MdlNumber: MFCD21332993
Smiles: [O-][N+](=O)c1cccc(c1)c1ccc(c(c1)Cl)F
Complexity: 284
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 4.1
CatalogNumber:
AD72454
ChemicalName:
2-Chloro-1-fluoro-4-(3-nitrophenyl)benzene
CasNumber:
1355247-49-2
MolecularFormula:
C12H7ClFNO2
MolecularWeight:
251.6409
MdlNumber:
MFCD21332993
Smiles:
[O-][N+](=O)c1cccc(c1)c1ccc(c(c1)Cl)F
Complexity:
284
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
4.1